input word = C00059211

Metabolite InformationStructural formula
Name Triptofordin E
Formula C35H38O13
Mw 666.2312413
CAS RN 111950-43-7
C_ID C00059211
InChIKey YBVNNKHLQUZXTL-DDEUFHSZSA-N
InChICode InChI=1S/C35H38O13/c1-19(36)43-18-34-27(46-30(40)22-13-9-7-10-14-22)24(44-20(2)37)17-33(6,42)35(34)28(45-21(3)38)25(32(4,5)48-35)26(39)29(34)47-31(41)23-15-11-8-12-16-23/h7-16,24-25,27-29,42H,17-18H2,1-6H3/t24-,25+,27-,28+,29+,33-,34-,35-/m0/s1
SMILES CC(=O)OCC12C(OC(=O)c3ccccc3)C(=O)C3C(OC(C)=O)C1(OC3(C)C)C(C)(O)CC(OC(C)=O)C2OC(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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